Nombre: N-(5-tert-butyl-2-methoxy-3-{3-[4-(2-morpholin-4-yl-ethoxy)-naphthalen-1-yl]-2,5-dioxo-2,5-dihydro-pyrrol-1-yl}-phenyl)-methanesulfonamide
SMILES:
COc1c(NS(C)(=O)=O)cc(C(C)(C)C)cc1N1C(=O)C=C(c2ccc(OCCN3CCOCC3)c3ccccc23)C1=OMolecular Processing
Molecular formula
C32H37N3O7S
Molecular weight
607.73
Exact mass
607.2352
XLogP
4.19
TPSA
114.48
H-bond donors
1
H-bond acceptors
8
Rotatable bonds
9
Heavy atoms
43
Rings
5
Aromatic rings
3
Saturated rings
1
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.375
Molar refractivity
167.33
Supplementary Information
Obteniendo detalles…
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